(4-chloranyl-3-ethyl-phenyl) 3-acetamido-4-methoxy-benzenesulfonate

Systemtic Name: (4-chloranyl-3-ethyl-phenyl) 3-acetamido-4-methoxy-benzenesulfonate Openeye Name: (4-chloro-3-ethyl-phenyl) 3-acetamido-4-methoxy-benzenesulfonate CAS Name: 3-acetamido-4-methoxybenzenesulfonic acid (4-chloro-3-ethylphenyl) ester IUPAC Name: (4-chloro-3-ethylphenyl) 3-acetamido-4-methoxybenzenesulfonate Traditional Name: 3-acetamido-4-methoxy-benzenesulfonic acid (4-chloro-3-ethyl-phenyl) ester Formula: C17H18ClNO5S MolecularWeight: 383.84652

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)OS(=O)(=O)C2=CC(=C(C=C2)OC)NC(=O)C)Cl

Isomeric SMILES

CCC1=C(C=CC(=C1)OS(=O)(=O)C2=CC(=C(C=C2)OC)NC(=O)C)Cl

InChI

InChI=1S/C17H18ClNO5S/c1-4-12-9-13(5-7-15(12)18)24-25(21,22)14-6-8-17(23-3)16(10-14)19-11(2)20/h5-10H,4H2,1-3H3,(H,19,20)